SCHEMBL7865763

SCHEMBL7865763

Cc1[nH]c2ccccc2c1CCN1CCN(C(c2ccc(F)cc2)c2ccc(F)cc2)CC1

nearest known ligand 0.58

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ ACHE P22303 4/20 0.52
▸ LMNA P02545 2/20 0.50
▸ MAPT P10636 2/20 0.50
▸ GAA P10253 1/20 0.50
▸ HTR7 P34969 2/20 0.45
▸ HTR2A P28223 4/20 0.44
▸ DRD2 P14416 2/20 0.44
▸ DRD3 P35462 2/20 0.44
▸ DRD4 P21917 1/20 0.44
▸ ALDH1A1 P00352 1/20 0.44
▸ TSHR P16473 1/20 0.44
▸ HTT P42858 1/20 0.44
▸ CYP2D6 P10635 2/20 0.44
▸ HTR2C P28335 2/20 0.44
▸ MEN1 O00255 1/20 0.44
▸ CYP1A2 P05177 1/20 0.44
▸ CYP3A4 P08684 1/20 0.44
▸ CYP2C9 P11712 1/20 0.44
▸ MAPK1 P28482 1/20 0.44
▸ THPO P40225 1/20 0.44

Click a target to see other patent compounds predicted against it — the reverse direction, in place.

Similar compounds — the chemically nearest patent molecules

Nearest neighbours by Morgan-fingerprint cosine across the patent-compound collection, with each neighbour's top predicted target and the predicted targets it shares with this molecule.

Compoundsimilaritytop predictedshared targets
SCHEMBL7875169 0.80 CACNA2D1 (0.55) LMNAMAPTGAAALDH1A1HTT
SCHEMBL28788491 0.79 HTT (0.56) MAPTGAAHTR7HTR2ADRD2
SCHEMBL26508424 0.78 HTR2A (0.68) MAPTGAAHTR7HTR2ADRD2
SCHEMBL11679502 0.77 HTT (0.54) MAPTGAAHTR7HTR2ADRD2
SCHEMBL11734080 0.77 HTR2A (0.45) MAPTHTR7HTR2ADRD2ALDH1A1
SCHEMBL11840524 0.76 CYP2D6 (0.51) MAPTHTR7HTR2AALDH1A1TSHR
SCHEMBL11333760 0.75 DRD2 (0.69) LMNAMAPTHTR7HTR2ADRD2
SCHEMBL10670064 0.74 TSHR (0.54) MAPTGAAHTR7HTR2ADRD2
SCHEMBL10682684 0.73 SIGMAR1 (0.62) HTR1ASIGMAR1
SCHEMBL11335321 0.72 HTR1A (0.68) LMNAMAPTHTR7HTR2ADRD2

Similarity is cosine over the 2,048-bit Morgan fingerprint (≈ Tanimoto). Identical fingerprints score 1.00.

Patent provenance — the patents this molecule appears in, and who filed them

Claimed or disclosed in 2 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-H2007-H1 INSECTICIDES FMC CORPORATION 2001-12-04 — — US disclosed
WO-1997026252-A1 INSECTICIDAL N-HETEROCYCLYLALKYL- OR N-[(POLYCYCLYL)-ALKYL]-N'-SUBSTITUTED PIPERAZINES FMC CORPORATION (US) 1997-07-24 — — WO disclosed
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